1-[4-(3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-3-(2,5-dimethyl-1H-pyrrol-1-yl)propan-1-one
Chemical Structure Depiction of
1-[4-(3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-3-(2,5-dimethyl-1H-pyrrol-1-yl)propan-1-one
1-[4-(3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-3-(2,5-dimethyl-1H-pyrrol-1-yl)propan-1-one
Compound characteristics
| Compound ID: | Y042-1946 |
| Compound Name: | 1-[4-(3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-3-(2,5-dimethyl-1H-pyrrol-1-yl)propan-1-one |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C18 H27 N5 O3 S |
| Smiles: | Cc1c(c(C)[nH]n1)S(N1CCN(CC1)C(CCn1c(C)ccc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5893 |
| logD: | 0.5893 |
| logSw: | -2.2461 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.189 |
| InChI Key: | KSGKEHCLIXNNJZ-UHFFFAOYSA-N |